SCHEMBL28406233

SCHEMBL28406233

CC(CO)NCC(O)Cn1c2ccccc2c2cc(F)ccc21

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CRY1 Q16526 10/20 0.56
▸ CRY2 Q49AN0 10/20 0.56
▸ PER2 O15055 9/20 0.56
▸ DNM1 Q05193 3/20 0.54
▸ BACE1 P56817 1/20 0.48
▸ MEN1 O00255 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29448051 0.94 CRY2 (0.62) CRY1CRY2PER2
SCHEMBL28398765 0.94 CRY2 (0.62) CRY1CRY2PER2
SCHEMBL28410416 0.83 DNM1 (0.62) CRY1CRY2PER2DNM1
SCHEMBL28425309 0.82 BACE1 (0.71) CRY1CRY2PER2DNM1BACE1
SCHEMBL29623019 0.82 BACE1 (0.71) CRY1CRY2PER2DNM1BACE1
SCHEMBL29622976 0.82 BACE1 (0.71) CRY1CRY2PER2DNM1BACE1
SCHEMBL29448056 0.80 BACE1 (0.53) CRY1CRY2PER2DNM1BACE1
SCHEMBL28429472 0.80 BACE1 (0.53) CRY1CRY2PER2DNM1BACE1
SCHEMBL28402100 0.80 DNM1 (0.58) CRY1CRY2PER2DNM1
SCHEMBL28406050 0.76 CRY2 (0.64) CRY1CRY2PER2DNM1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111217741-B Fluorine-substituted monocarbazole derivative, preparation method and application thereof 广东省中医院(广州中医药大学第二附属医院、广州中医药大学第二临床医学院、广东省中医药科学院) 2022-03-15 — — CN disclosed
CN-111217741-A Fluorine-substituted monocarbazole derivative, preparation method and application thereof 广东省中医院(广州中医药大学第二附属医院、广州中医药大学第二临床医学院、广东省中医药科学院) 2020-06-02 — — CN disclosed
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